In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (3S)-3-[[(1S)-3-methoxy-1,3-dimethyl-butyl]amino]-3-(2-thienyl)propanoic (3S)-3-[[(1S)-3-methoxy-1,3-dime…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.49 | 7.34 | -28.25 | 2 | 4 | 0 | 66 | 285.409 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.49 | 6.02 | -45.58 | 1 | 4 | -1 | 61 | 284.401 | 8 | ↓ |